SCHEMBL31442154

SCHEMBL31442154

CC(C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)NCC(=O)O)C(C)C

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 2/20 0.56
▸ CALCRL Q16602 1/20 0.54
▸ OPRM1 P35372 2/20 0.49
▸ OPRD1 P41143 2/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31442235 0.93 GHSR (0.57) GHSRCALCRL
SCHEMBL31018989 0.92 GHSR (0.58) GHSRCALCRL
SCHEMBL31442185 0.91 GHSR (0.54) GHSRCALCRL
SCHEMBL31442345 0.90 GHSR (0.58) GHSROPRM1OPRD1
SCHEMBL31442128 0.90 GHSR (0.54) GHSRCALCRL
SCHEMBL31442238 0.90 GHSR (0.55) GHSRCALCRL
SCHEMBL31442242 0.89 GHSR (0.53) GHSR
SCHEMBL31442166 0.87 GHSR (0.51) GHSR
SCHEMBL31442130 0.87 GHSR (0.55) GHSR
SCHEMBL30051691 0.85 GHSR (0.61) GHSR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12234299-B2 Peptides for inducing bacteriocin synthesis and methods to identify and/or select and/or optimize the same SYNGULON S.A. (BE) 2025-02-25 — — US disclosed
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